(4S)-6-[(diethylazaniumyl)methyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: (4S)-6-[(diethylazaniumyl)methyl]-2-oxidanylidene-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (4S)-6-[(diethylammonio)methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[(diethylammonio)methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate IUPAC Name: (4S)-6-[(diethylazaniumyl)methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-6-[(diethylammonio)methyl]-2-keto-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C(NC(=O)N1)C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC[NH+](CC)CC1=C([C@@H](NC(=O)N1)C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C16H21N3O3/c1-3-19(4-2)10-12-13(15(20)21)14(18-16(22)17-12)11-8-6-5-7-9-11/h5-9,14H,3-4,10H2,1-2H3,(H,20,21)(H2,17,18,22)/t14-/m0/s1